(2S,4S)-2-(3-methoxy-4-propoxy-phenyl)-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: (2S,4S)-2-(3-methoxy-4-propoxy-phenyl)-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2S,4S)-2-(3-methoxy-4-propoxy-phenyl)thiazolidin-3-ium-4-carboxylate CAS Name: (2S,4S)-2-(3-methoxy-4-propoxyphenyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2S,4S)-2-(3-methoxy-4-propoxyphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2S,4S)-2-(3-methoxy-4-propoxy-phenyl)thiazolidin-3-ium-4-carboxylate Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2[NH2+]C(CS2)C(=O)[O-])OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@H]2[NH2+][C@H](CS2)C(=O)[O-])OC

InChI

InChI=1S/C14H19NO4S/c1-3-6-19-11-5-4-9(7-12(11)18-2)13-15-10(8-20-13)14(16)17/h4-5,7,10,13,15H,3,6,8H2,1-2H3,(H,16,17)/t10-,13+/m1/s1